[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-(3-fluoranyl-4-methyl-phenyl)methanone

Systemtic Name: [4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-(3-fluoranyl-4-methyl-phenyl)methanone Openeye Name: [4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-(3-fluoro-4-methyl-phenyl)methanone CAS Name: [4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]-(3-fluoro-4-methylphenyl)methanone IUPAC Name: [4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-(3-fluoro-4-methylphenyl)methanone Traditional Name: [4-(3,4-dimethoxyphenyl)sulfonylpiperazino]-(3-fluoro-4-methyl-phenyl)methanone Formula: C20H23FN2O5S MolecularWeight: 422.470423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)OC)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)OC)F

InChI

InChI=1S/C20H23FN2O5S/c1-14-4-5-15(12-17(14)21)20(24)22-8-10-23(11-9-22)29(25,26)16-6-7-18(27-2)19(13-16)28-3/h4-7,12-13H,8-11H2,1-3H3